Saddle Points and Dynamics of Lennard-Jones Clusters, Solids and Supercooled Liquids

The properties of higher-index saddle points have been invoked in recent theories of the dynamics of supercooled liquids. Here we examine in detail a mapping of configurations to saddle points using minimization of $|\nabla E|^2$, which has been used in previous work to support these theories. The e...

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Bibliografske podrobnosti
Main Authors: Doye, J, Wales, D
Format: Journal article
Jezik:English
Izdano: American Institute of Physics 2001

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